dodecyl 2-[1-(3-butan-2-yloxyphenyl)carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: dodecyl 2-[1-(3-butan-2-yloxyphenyl)carbonyl-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: dodecyl 2-[3-oxo-1-(3-sec-butoxybenzoyl)piperazin-2-yl]acetate CAS Name: 2-[1-[(3-butan-2-yloxyphenyl)-oxomethyl]-3-oxo-2-piperazinyl]acetic acid dodecyl ester IUPAC Name: dodecyl 2-[1-(3-butan-2-yloxybenzoyl)-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[3-keto-1-(3-sec-butoxybenzoyl)piperazin-2-yl]acetic acid lauryl ester Formula: C29H46N2O5 MolecularWeight: 502.68594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)CC1C(=O)NCCN1C(=O)C2=CC(=CC=C2)OC(C)CC

Isomeric SMILES

CCCCCCCCCCCCOC(=O)CC1C(=O)NCCN1C(=O)C2=CC(=CC=C2)OC(C)CC

InChI

InChI=1S/C29H46N2O5/c1-4-6-7-8-9-10-11-12-13-14-20-35-27(32)22-26-28(33)30-18-19-31(26)29(34)24-16-15-17-25(21-24)36-23(3)5-2/h15-17,21,23,26H,4-14,18-20,22H2,1-3H3,(H,30,33)